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2-(5-Acetyl-3-cyano-6-methyl-4-phenyl-2-pyridinyl)malononitrile
SpectraBase Compound ID fW91NtLIxC
InChI InChI=1S/C18H12N4O/c1-11-16(12(2)23)17(13-6-4-3-5-7-13)15(10-21)18(22-11)14(8-19)9-20/h3-7,14H,1-2H3
InChIKey KWUKMBRIQMUBKW-UHFFFAOYSA-N
Mol Weight 300.32 g/mol
Molecular Formula C18H12N4O
Exact Mass 300.101111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wVzh3vyHL2
Name 2-(5-Acetyl-3-cyano-6-methyl-4-phenyl-2-pyridinyl)malononitrile
CAS Registry Number 294874-44-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N4O
InChI InChI=1S/C18H12N4O/c1-11-16(12(2)23)17(13-6-4-3-5-7-13)15(10-21)18(22-11)14(8-19)9-20/h3-7,14H,1-2H3
InChIKey KWUKMBRIQMUBKW-UHFFFAOYSA-N
Molecular Weight 300.321 g/mol
SMILES c1(c(c(C(=O)C)c(nc1C(C#N)C#N)C)-c1ccccc1)C#N
SPLASH splash10-000f-9450000000-62c57141e737d3d62321
Source of Spectrum AD-0-2532-0
Synonyms 2-(3-cyano-5-ethanoyl-6-methyl-4-phenyl-pyridin-2-yl)propanedinitrile 2-(5-acetyl-3-cyano-6-methyl-4-phenyl-2-pyridinyl)propanedinitrile 2-(5-acetyl-3-cyano-6-methyl-4-phenyl-2-pyridyl)malononitrile 2-(5-acetyl-3-cyano-6-methyl-4-phenyl-2-pyridyl)propanedinitrile 2-(5-acetyl-3-cyano-6-methyl-4-phenylpyridin-2-yl)propanedinitrile Pyridine-3-carbonitrile, 5-acetyl-2-dicyanomethyl-6-methyl-4-phenyl-
Wiley ID 1420733